Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | CBX7 | O95931 | 1/20 | 0.48 |
| ▸ | CDYL2 | Q8N8U2 | 1/20 | 0.48 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.48 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL15790781 | 0.83 | TSHR (0.56) | TSHRMEN1KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL11634572 | 0.82 | SLC6A2 (0.48) | TSHRMEN1KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL4097858 | 0.80 | TSHR (0.62) | TSHRMEN1KMT2APOLBCYP2C19 | |
| SCHEMBL15835892 | 0.78 | HTR7 (0.48) | DRD4 | |
| SCHEMBL474614 | 0.78 | TSHR (0.60) | TSHRMEN1KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL9214610 | 0.75 | ALDH1A1 (0.58) | TSHRMEN1KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL4428995 | 0.75 | TSHR (0.57) | TSHRMEN1KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL15690661 | 0.75 | ALDH1A1 (0.58) | TSHRMEN1KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL7358743 | 0.75 | ALDH1A1 (0.61) | TSHRMEN1KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL3641417 | 0.75 | ALDH1A1 (0.58) | TSHRMEN1KMT2AL3MBTL1ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114230537-B | 2H-1, 4-benzoxazine-3 (4H) -ketone compound containing propanolamine structure and application thereof | 贵州省茶叶研究所 | 2023-07-21 | — | — | CN | disclosed |